N-[2-(methoxymethyl)phenyl]-1-propan-2-ylpiperidin-4-amine

C16H26N2O — CID 43677869

IUPACN-[2-(methoxymethyl)phenyl]-1-propan-2-ylpiperidin-4-amine
SMILESCOCc1ccccc1NC1CCN(C(C)C)CC1
InChIInChI=1S/C16H26N2O/c1-13(2)18-10-8-15(9-11-18)17-16-7-5-4-6-14(16)12-19-3/h4-7,13,15,17H,8-12H2,1-3H3
InChIKeyIAEWGOZNLWFVPL-UHFFFAOYSA-N
MW262.40 g/mol
LogP3.12
Rot. Bonds5

About N-[2-(methoxymethyl)phenyl]-1-propan-2-ylpiperidin-4-amine

N-[2-(methoxymethyl)phenyl]-1-propan-2-ylpiperidin-4-amine (PubChem CID 43677869) has the molecular formula C16H26N2O and a molecular weight of 262.40 g/mol. Its IUPAC name is N-[2-(methoxymethyl)phenyl]-1-propan-2-ylpiperidin-4-amine.

Molecular Properties

Compound NameN-[2-(methoxymethyl)phenyl]-1-propan-2-ylpiperidin-4-amine
PubChem CID43677869
Molecular FormulaC16H26N2O
Molecular Weight262.40 g/mol
Exact Mass262.20
IUPAC NameN-[2-(methoxymethyl)phenyl]-1-propan-2-ylpiperidin-4-amine
SMILESCOCc1ccccc1NC1CCN(C(C)C)CC1
InChIInChI=1S/C16H26N2O/c1-13(2)18-10-8-15(9-11-18)17-16-7-5-4-6-14(16)12-19-3/h4-7,13,15,17H,8-12H2,1-3H3
InChIKeyIAEWGOZNLWFVPL-UHFFFAOYSA-N
XLogP3.12
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-propan-2-yl-N-(2-propylphenyl)piperidin-4-amine
CID 43687285
2-(methoxymethyl)-N-(4-propan-2-ylcyclohexyl)aniline
CID 62701624
N-[2-(methoxymethyl)phenyl]cyclooctanamine
CID 43677867
N-(2-methoxyphenyl)-1-propan-2-ylpiperidin-4-amine
CID 5131485
N-[[2-(methoxymethyl)phenyl]methyl]-1-propan-2-ylazepan-4-amine
CID 65073415
N-(2-ethylsulfonylphenyl)-1-propan-2-ylpiperidin-4-amine
CID 43738170
2-N,2-N-dimethyl-1-N-(1-propan-2-ylpiperidin-4-yl)benzene-1,2-diamine
CID 43726465
N-[2-(methoxymethyl)phenyl]-4,4-dimethylcycloheptan-1-amine
CID 65084084
N-[2-(ethoxymethyl)phenyl]-1-(2-methylpropyl)piperidin-4-amine
CID 103931357
N-[3-[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]-2-methylphenyl]-1-propan-2-ylpiperidin-4-amine
CID 86786866
4-tert-butyl-N-[2-(methoxymethyl)phenyl]cycloheptan-1-amine
CID 65089478
N-(2-nitrophenyl)-1-propan-2-ylpiperidin-4-amine
CID 43222290

Frequently Asked Questions

What is the IUPAC name of N-[2-(methoxymethyl)phenyl]-1-propan-2-ylpiperidin-4-amine?
The IUPAC name of N-[2-(methoxymethyl)phenyl]-1-propan-2-ylpiperidin-4-amine (CID 43677869) is N-[2-(methoxymethyl)phenyl]-1-propan-2-ylpiperidin-4-amine.
What is the SMILES notation for N-[2-(methoxymethyl)phenyl]-1-propan-2-ylpiperidin-4-amine?
The canonical SMILES for N-[2-(methoxymethyl)phenyl]-1-propan-2-ylpiperidin-4-amine is COCc1ccccc1NC1CCN(C(C)C)CC1.
What is the InChIKey of N-[2-(methoxymethyl)phenyl]-1-propan-2-ylpiperidin-4-amine?
The InChIKey is IAEWGOZNLWFVPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O/c1-13(2)18-10-8-15(9-11-18)17-16-7-5-4-6-14(16)12-19-3/h4-7,13,15,17H,8-12H2,1-3H3.
What are the key properties of N-[2-(methoxymethyl)phenyl]-1-propan-2-ylpiperidin-4-amine?
N-[2-(methoxymethyl)phenyl]-1-propan-2-ylpiperidin-4-amine has a molecular weight of 262.40 g/mol, XLogP of 3.12, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(methoxymethyl)phenyl]-1-propan-2-ylpiperidin-4-amine is sourced from PubChem (CID 43677869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).